SCHEMBL2013427

SCHEMBL2013427

Cc1[nH]c2ccccc2c1-c1ncccn1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 1/20 0.62
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
KDM4E B2RXH2 5/20 0.54
ALDH1A1 P00352 5/20 0.54
MAPT P10636 5/20 0.54
LMNA P02545 3/20 0.54
HPGD P15428 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
HSD17B10 Q99714 2/20 0.54
AHR P35869 1/20 0.52
CYP1A2 P05177 3/20 0.51
GAA P10253 3/20 0.51
CYP2C9 P11712 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
USP2 O75604 1/20 0.51
EIF2AK2 P19525 6/20 0.49
CCR6 P51684 1/20 0.47
HKDC1 Q2TB90 1/20 0.47
HTR2A P28223 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11287982 0.84 IMPDH2 (0.60) IMPDH2MEN1KMT2AKDM4EALDH1A1
SCHEMBL31060312 0.76 IMPDH2 (1.00) IMPDH2MEN1KMT2AKDM4EALDH1A1
SCHEMBL19100789 0.76 IMPDH2 (0.64) IMPDH2MEN1KMT2AKDM4EALDH1A1
SCHEMBL14758442 0.75 KDM4E (0.55) IMPDH2MEN1KMT2AKDM4EALDH1A1
SCHEMBL18457731 0.75 MAPT (0.55) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL17383846 0.75 IMPDH2 (0.73) IMPDH2MEN1KMT2AKDM4EALDH1A1
SCHEMBL1720216 0.74 CYP1A2 (0.55) IMPDH2MEN1KMT2AKDM4EALDH1A1
SCHEMBL18392175 0.73 CCR6 (0.58) IMPDH2MEN1KMT2AKDM4EALDH1A1
SCHEMBL10067256 0.73 MEN1 (0.56) IMPDH2MEN1KMT2AKDM4EALDH1A1
SCHEMBL13561069 0.73 LMNA (0.66) IMPDH2MEN1KMT2AKDM4EALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102006902-B Anti-infectious catheter ANGIOTECH INTERNATIONAL AG (CH) 2015-10-07 CN disclosed
US-20110150961-A1 ANTI-INFECTIVE CATHETERS ANGIOTECH INTERNATIONAL AG (CH) 2011-06-23 US disclosed
CN-102006902-A Anti-infective catheters ANGIOTECH INT AG 2011-04-06 CN disclosed
CN-1186339-C Pyrimidinyl methyl indole derivatives with antibacterial activity BASLYER PHARMACEUTICAL AG (CH) 2005-01-26 CN disclosed
CN-1186339-C Pyrimidinyl methyl indole derivatives with antibacterial activity BASLYER PHARMACEUTICAL AG (CH) 2005-01-26 CN disclosed
US-6703397-B2 REACTING A NITRILE GROUP CONTAINING INDOLE DERIVEATIVE WITH GUANIDINE OR SALT; USEFUL AS PROHYLAXIS OR THERAPEUTICAL TREATMENT OF INFECTIOUS DISEASES BASILEA PHARMACEUTICA AG (CH) 2004-03-09 US disclosed
US-20030119857-A1 Pyrimidinyl methyl indole derivatives with antibacterial activity BASILEA PHARMACEUTICA AG (CH) 2003-06-26 US disclosed
CN-1426408-A Pyrimidinyl methyl indole derivatives with antibacterial activity BASLYER PHARMACEUTICAL AG (CH) 2003-06-25 CN disclosed
CN-1426408-A Pyrimidinyl methyl indole derivatives with antibacterial activity BASLYER PHARMACEUTICAL AG (CH) 2003-06-25 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110150961-A1 ANTI-INFECTIVE CATHETERS NACA, PUF60, POLR1C IMPDH2 1038/4885MEN1 4611/4885KMT2A 2534/4885
US-20030119857-A1 Pyrimidinyl methyl indole derivatives with antibacterial activity IDO1, IDO2, AANAT IMPDH2 116/4885MEN1 4153/4885KMT2A 1379/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.